2-Imino-3,4-dimethyl-5-phenylthiazolidine theophyllin-7-yl acetate
[CAS# 74347-30-1]

Identification

• Name: 2-Imino-3,4-dimethyl-5-phenylthiazolidine theophyllin-7-yl acetate
• Synonyms: 2-(1,3-Dimethyl-2,6-Dioxo-Purin-7-Yl)Acetate; 3,4-Dimethyl-5-Phenyl-Thiazolidin-2-Imine; 2-(1,3-Dimethyl-2,6-Dioxo-7-Purinyl)Acetate; 3,4-Dimethyl-5-Phenyl-2-Thiazolidinimine; 2-(2,6-Diketo-1,3-Dimethyl-Purin-7-Yl)Acetate; (3,4-Dimethyl-5-Phenyl-Thiazolidin-2-Ylidene)Amine
• Molecular Formula: C₂₀H₂₃N₆O₄S
• Molecular Weight: 443.50
• CAS Registry Number: 74347-30-1
• EINECS: 277-831-2
• SMILES: C2=C(C1SC(N(C1C)C)=N)C=CC=C2.C3=NC4=C([N]3CC([O-])=O)C(=O)N(C(=O)N4C)C
• InChI: 1S/C11H14N2S.C9H10N4O4/c1-8-10(14-11(12)13(8)2)9-6-4-3-5-7-9;1-11-7-6(8(16)12(2)9(11)17)13(4-10-7)3-5(14)15/h3-8,10,12H,1-2H3;4H,3H2,1-2H3,(H,14,15)/p-1
• InChIKey: BKWSJDFLCCQAGZ-UHFFFAOYSA-M